Amber Archive Oct 2005 by messages with attachments

254 messages: Starting Mon Oct 03 2005 - 13:53:00 PDT, Ending Mon Oct 31 2005 - 23:53:01 PST
This period: Most recent messages
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AMBER: QMMM question xiaoqin huang (Thu Oct 06 2005 - 21:09:53 PDT)
1. dist.RST (350 bytes)
2. miniQMMM.in.in (346 bytes)
3. mdQMMM.in.in (677 bytes)
4. divcon.in (54 bytes)
5. rejects (2111 bytes)
Re: AMBER: question about grid in ptraj Angelo Pugliese (Fri Oct 07 2005 - 02:23:17 PDT)
1. angelo.vcf (274 bytes)
Re: AMBER: QMMM question xiaoqin huang (Mon Oct 10 2005 - 11:59:55 PDT)
1. pmf1.in (1146 bytes)
AMBER: antechamber -- missing improper torsions David Mobley (Mon Oct 17 2005 - 11:33:43 PDT)
1. fmn.pdb (6057 bytes)
Re: Re: AMBER: F,Cl,Br,I in MMPBSA Yong Xu (Thu Oct 20 2005 - 18:12:15 PDT)
1. no222_1.top (8295 bytes)
2. no222_1.crd (230 bytes)
3. no222_1.frcmod (1402 bytes)
4. no222_1.gjf (420 bytes)
5. no222_1.mol2 (1199 bytes)
6. no222_1.out (292822 bytes)
7. no222_1.pdb (410 bytes)
8. no222_1.prep (791 bytes)
Re: (2) Re: AMBER: F,Cl,Br,I in MMPBSA Yong Xu (Thu Oct 20 2005 - 18:21:33 PDT)
1. no137_1.prep (1404 bytes)
2. no383_1.frcmod (62 bytes)
3. no383_1.gjf (530 bytes)
4. no383_1.mol2 (1418 bytes)
5. no383_1.out (273360 bytes)
6. no383_1.prep (931 bytes)
7. no137_1.frcmod (62 bytes)
8. no137_1.gjf (860 bytes)
9. no137_1.mol2 (2087 bytes)
10. no137_1.out (413410 bytes)
Re: AMBER: antechamber -- missing improper torsions David Mobley (Fri Oct 21 2005 - 10:21:01 PDT)
1. fmn.pdb (6057 bytes)
Modification of GAMESS outputs for resp jobs Re: AMBER: Cu++ and RED Cenk Andac (Sat Oct 22 2005 - 11:02:00 PDT)
1. outputs.zip (165422 bytes)